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A1AH2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CC1sing1.53Å1.53Å
C1C2sing1.53Å1.52Å
C2Osing1.43Å1.45Å
OC3sing1.35Å1.36Å
C3C4doub1.38Å1.36Å
C4C5sing1.40Å1.43Å
NC5sing1.35Å1.40Å
C6Nsing1.46Å1.47Å
C7C6sing1.53Å1.51Å
O1C7sing1.45Å1.45Å
C8O1sing1.35Å1.35Å
N1C8sing1.35Å1.34Å
C9N1sing1.47Å1.46Å
C10C9sing1.51Å1.51Å
C10C11doub1.38Å1.39ÅAromatic
C11C12sing1.39Å1.39ÅAromatic
C13C12sing1.48Å1.47Å
C13C14doub1.36Å1.37ÅAromatic
C14N2sing1.37Å1.37ÅAromatic
N2C15sing1.35Å1.34ÅAromatic
C15N3doub1.30Å1.33ÅAromatic
N3C13sing1.35Å1.38ÅAromatic
C12C16doub1.39Å1.39ÅAromatic
C16C17sing1.38Å1.38ÅAromatic
C17C18doub1.38Å1.38ÅAromatic
C18C10sing1.38Å1.39ÅAromatic
O2C8doub1.21Å1.21Å
C19Nsing1.36Å1.38Å
C20C19sing1.51Å1.49Å
C21C19doub1.35Å1.36Å
C3C21sing1.41Å1.43Å
C5O3doub1.22Å1.23Å
C22C1sing1.51Å1.52Å
C22C23doub1.38Å1.39ÅAromatic
C23C24sing1.38Å1.39ÅAromatic
C24C25doub1.38Å1.38ÅAromatic
C25C26sing1.38Å1.38ÅAromatic
C26C27doub1.38Å1.38ÅAromatic
C27C22sing1.38Å1.39ÅAromatic
C4H6sing1.08Å1.08Å
C6H8sing1.09Å1.10Å
C6H7sing1.09Å1.10Å
N1H11sing0.97Å1.00Å
C2H4sing1.09Å1.10Å
C2H5sing1.09Å1.10Å
CH1sing1.09Å1.10Å
CHsing1.09Å1.10Å
CH2sing1.09Å1.10Å
C1H3sing1.09Å1.10Å
C11H14sing1.08Å1.08Å
C14H15sing1.08Å1.08Å
C15H17sing1.08Å1.08Å
C16H18sing1.08Å1.08Å
C17H19sing1.08Å1.08Å
C18H20sing1.08Å1.08Å
C20H23sing1.09Å1.10Å
C20H21sing1.09Å1.10Å
C20H22sing1.09Å1.10Å
C21H24sing1.08Å1.08Å
C23H25sing1.08Å1.08Å
C24H26sing1.08Å1.08Å
C25H27sing1.08Å1.08Å
C26H28sing1.08Å1.08Å
C27H29sing1.08Å1.08Å
C7H9sing1.09Å1.10Å
C7H10sing1.09Å1.10Å
C9H13sing1.09Å1.10Å
C9H12sing1.09Å1.10Å
N2H16sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CC1C2110.4°109.4°
CC1C22111.8°109.5°
C1CH1109.5°109.4°
C1CH109.5°109.5°
C1CH2109.4°109.5°
CC1H3107.7°109.5°
C1C2O106.6°109.5°
C2C1C22111.1°109.4°
C1C2H4110.2°109.5°
C1C2H5110.2°109.5°
C2C1H3107.8°109.5°
C2OC3118.1°117.0°
OC2H4110.2°109.5°
OC2H5110.2°109.4°
OC3C4125.6°120.5°
OC3C21113.6°120.6°
C3C4C5121.0°119.1°
C4C3C21120.7°119.0°
C3C4H6119.5°120.5°
C4C5N116.2°120.2°
C4C5O3124.9°119.9°
C5C4H6119.5°120.4°
C5NC6116.1°119.5°
C5NC19122.8°121.0°
NC5O3118.9°119.9°
NC6C7112.8°109.4°
C6NC19121.0°119.5°
NC6H8108.6°109.5°
NC6H7108.6°109.4°
C6C7O1106.7°109.5°
C7C6H8108.7°109.5°
C7C6H7108.7°109.5°
C6C7H9110.1°109.4°
C6C7H10110.1°109.5°
C7O1C8116.2°117.0°
O1C7H9110.2°109.5°
O1C7H10110.2°109.5°
O1C8N1110.3°120.0°
O1C8O2124.6°120.1°
C8N1C9128.6°120.0°
N1C8O2125.1°120.0°
C8N1H11115.7°120.0°
N1C9C10114.8°109.4°
C9N1H11115.7°120.0°
N1C9H13108.1°109.5°
N1C9H12108.1°109.5°
C9C10C11121.1°119.9°
C9C10C18120.0°119.9°
C10C9H13108.1°109.4°
C10C9H12108.1°109.4°
C10C11C12120.9°119.8°
C11C10C18118.9°120.2°
C10C11H14119.6°120.0°
C11C12C13120.4°120.1°
C11C12C16119.2°119.8°
C12C11H14119.6°120.1°
C12C13C14129.0°126.1°
C12C13N3122.1°126.2°
C13C12C16120.4°120.1°
C13C14N2106.5°106.7°
C14C13N3108.9°107.7°
C13C14H15126.7°126.7°
C14N2C15107.2°107.4°
N2C14H15126.7°126.6°
C14N2H16126.4°126.3°
N2C15N3112.0°109.0°
N2C15H17124.0°125.5°
C15N2H16126.4°126.3°
C15N3C13105.4°109.2°
N3C15H17124.0°125.5°
C12C16C17120.2°119.9°
C12C16H18119.9°120.1°
C16C17C18120.1°120.1°
C17C16H18119.9°120.0°
C16C17H19119.9°119.9°
C17C18C10120.7°120.2°
C18C17H19119.9°120.0°
C17C18H20119.6°119.9°
C10C18H20119.6°119.9°
NC19C20119.1°119.6°
NC19C21120.1°120.9°
C20C19C21120.8°119.6°
C19C20H23109.5°109.5°
C19C20H21109.5°109.5°
C19C20H22109.4°109.5°
C19C21C3119.2°119.9°
C19C21H24120.4°120.0°
C3C21H24120.4°120.1°
C1C22C23120.7°120.0°
C1C22C27120.9°120.0°
C22C1H3107.8°109.5°
C22C23C24120.7°120.0°
C23C22C27118.4°120.0°
C22C23H25119.6°120.0°
C23C24C25120.2°120.0°
C24C23H25119.6°120.0°
C23C24H26119.9°120.0°
C24C25C26119.6°120.0°
C25C24H26119.9°120.0°
C24C25H27120.2°120.0°
C25C26C27120.3°120.0°
C26C25H27120.2°120.0°
C25C26H28119.9°120.0°
C26C27C22120.7°120.0°
C27C26H28119.9°120.0°
C26C27H29119.6°120.0°
C22C27H29119.7°120.0°
H8C6H7109.5°109.5°
H4C2H5109.4°109.5°
H1CH109.4°109.4°
H1CH2109.5°109.4°
HCH2109.5°109.5°
H23C20H21109.5°109.4°
H23C20H22109.5°109.5°
H21C20H22109.5°109.4°
H9C7H10109.5°109.5°
H13C9H12109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CC1C2C22124.7°120.0°
CC1C2H3117.4°120.0°
CC1C2O167.1°65.0°
CC1C22H3118.2°120.1°
CC1C22C23122.4°120.0°
CC1C22C2757.9°59.7°
CC1C2H473.3°55.0°
CC1C2H547.6°175.0°
C1CH1H120.0°120.0°
C1CH1H2120.0°120.0°
C1CHH2120.0°120.1°
C1C2OH4119.6°120.0°
C1C2OH5119.6°120.0°
C1C2OC3178.2°180.0°
C2C1C22H3117.9°120.0°
C2C1C22C23113.8°120.1°
C2C1C22C2765.9°60.3°
C1C2H4H5121.3°120.0°
C2C1CH1180.0°180.0°
C2C1CH60.0°60.1°
C2C1CH260.0°60.0°
C2OC3C417.3°0.0°
C2OC3C21165.5°179.5°
OC2C1C2268.2°175.0°
OC2H4H5121.3°120.0°
OC2C1H349.8°55.0°
OC3C4C21177.1°179.5°
OC3C4C5175.7°180.0°
OC3C21C19176.3°180.0°
OC3C4H64.3°0.3°
C3OC2H458.6°60.0°
C3OC2H562.3°60.0°
OC3C21H243.7°0.2°
C3C4C5H6180.0°179.7°
C3C4C5N0.3°0.3°
C4C3C21C191.2°0.5°
C3C4C5O3178.8°179.8°
C4C3C21H24178.8°179.7°
C4C5NO3179.1°179.9°
C4C5NC6175.5°180.0°
C4C5NC191.1°0.1°
C5C4C3C211.4°0.5°
C5NC6C19176.6°180.0°
C5NC6C7101.7°89.8°
C5NC19C20178.6°180.0°
C5NC19C211.3°0.1°
NC5C4H6179.7°180.0°
C5NC6H8137.8°30.2°
C5NC6H718.8°150.2°
NC6C7H8120.5°120.0°
NC6C7H7120.5°119.9°
NC6C7O1174.1°65.0°
C6NC19C205.0°0.0°
C6NC19C21175.1°180.0°
C6NC5O33.6°0.1°
NC6H8H7118.5°120.0°
NC6C7H954.5°175.0°
NC6C7H1066.4°55.0°
C6C7O1H9119.6°119.9°
C6C7O1H10119.5°120.0°
C6C7O1C8179.2°179.9°
C7C6NC1981.6°90.3°
C7C6H8H7118.5°120.1°
C6C7H9H10121.2°120.0°
C7O1C8N1175.7°180.0°
C7O1C8O23.9°0.0°
O1C7C6H865.4°55.0°
O1C7C6H753.6°175.0°
O1C7H9H10121.3°120.0°
O1C8N1O2179.6°180.0°
O1C8N1C9177.7°180.0°
O1C8N1H112.3°0.0°
C8O1C7H959.6°60.0°
C8O1C7H1061.3°60.0°
C8N1C9H11180.0°180.0°
C8N1C9C1045.2°180.0°
C8N1C9H1375.6°60.1°
C8N1C9H12166.0°60.0°
N1C9C10H13120.8°120.0°
N1C9C10H12120.8°120.0°
N1C9C10C1137.6°90.0°
N1C9C10C18143.5°90.3°
C9N1C8O22.7°0.0°
N1C9H13H12117.6°120.1°
C9C10C11C18178.9°179.7°
C9C10C11C12178.8°180.0°
C9C10C18C17178.6°179.8°
C10C9N1H11134.7°0.0°
C9C10C11H141.2°0.0°
C9C10C18H201.4°0.2°
C10C9H13H12117.6°119.9°
C10C11C12H14180.0°180.0°
C10C11C12C13179.0°180.0°
C10C11C12C160.2°0.0°
C11C10C18C170.3°0.5°
C11C10C18H20179.7°180.0°
C11C10C9H13158.4°30.0°
C11C10C9H1283.1°150.0°
C11C12C13C16179.1°180.0°
C11C12C13C1415.8°180.0°
C11C12C13N3163.9°0.1°
C11C12C16C170.3°0.0°
C12C11C10C180.1°0.2°
C11C12C16H18179.7°180.0°
C12C13C14N3179.7°179.9°
C12C13C14N2179.6°180.0°
C12C13N3C15179.6°180.0°
C13C12C16C17178.9°179.9°
C13C12C11H141.0°0.1°
C12C13C14H150.5°0.1°
C13C12C16H181.1°0.0°
C13C14N2H15180.0°179.9°
C13C14N2C150.1°0.0°
C14C13N3C150.1°0.1°
C14C13C12C16165.1°0.1°
C13C14N2H16179.9°179.9°
C14N2C15H16180.0°180.0°
C14N2C15N30.1°0.0°
N2C14C13N30.1°0.0°
C14N2C15H17179.9°180.0°
N2C15N3H17180.0°180.0°
N2C15N3C130.0°0.0°
C15N2C14H15179.9°179.9°
N3C15N2H16179.9°180.0°
N3C13C12C1615.3°180.0°
N3C13C14H15179.8°180.0°
C13N3C15H17180.0°180.0°
C12C16C17H18180.0°180.0°
C12C16C17C180.1°0.2°
C16C12C11H14179.8°180.0°
C12C16C17H19179.9°180.0°
C16C17C18H19180.0°179.8°
C16C17C18C100.2°0.5°
C16C17C18H20179.8°180.0°
C17C18C10H20180.0°179.5°
C18C17C16H18179.9°179.7°
C18C10C11H14179.9°179.8°
C10C18C17H19179.8°179.7°
C18C10C9H1322.7°149.7°
C18C10C9H1295.7°29.7°
O2C8N1H11177.3°180.0°
NC19C20C21179.9°180.0°
NC19C21C30.2°0.3°
C19NC5O3179.8°180.0°
C19NC6H838.9°149.7°
C19NC6H7157.8°29.7°
NC19C20H23180.0°84.8°
NC19C20H2160.0°155.2°
NC19C20H2260.0°35.2°
NC19C21H24179.8°180.0°
C20C19C21C3179.8°179.7°
C19C20H23H21120.0°120.0°
C19C20H23H22120.0°120.0°
C19C20H21H22120.0°120.1°
C20C19C21H240.2°0.0°
C19C21C3H24180.0°179.8°
C21C19C20H230.1°95.2°
C21C19C20H21120.1°24.8°
C21C19C20H22119.9°144.8°
C21C3C4H6178.6°179.8°
O3C5C4H61.2°0.1°
C1C22C23C27179.7°179.7°
C1C22C23C24179.6°180.0°
C1C22C27C26179.3°179.8°
C22C1C2H451.4°65.0°
C22C1C2H5172.2°55.1°
C22C1CH155.8°60.1°
C22C1CH175.8°180.0°
C22C1CH264.2°59.9°
C1C22C23H250.4°0.1°
C1C22C27H290.7°0.2°
C22C23C24H25180.0°179.9°
C22C23C24C250.3°0.1°
C23C22C27C260.4°0.5°
C23C22C1H34.2°0.1°
C22C23C24H26179.7°180.0°
C23C22C27H29179.6°179.9°
C23C24C25H26180.0°179.9°
C23C24C25C260.4°0.0°
C24C23C22C270.1°0.3°
C23C24C25H27179.6°180.0°
C24C25C26H27180.0°180.0°
C24C25C26C270.0°0.1°
C25C24C23H25179.7°180.0°
C24C25C26H28180.0°180.0°
C25C26C27H28180.0°179.9°
C25C26C27C220.4°0.4°
C26C25C24H26179.6°179.9°
C25C26C27H29179.6°180.0°
C26C27C22H29180.0°179.6°
C27C26C25H27180.0°179.9°
C27C22C1H3176.2°179.8°
C27C22C23H25179.9°179.8°
C22C27C26H28179.6°179.7°
H8C6C7H9175.0°65.0°
H8C6C7H1054.1°175.0°
H7C6C7H966.0°55.1°
H7C6C7H10173.1°64.9°
H11N1C9H13104.5°120.0°
H11N1C9H1214.0°119.9°
H4C2C1H3169.3°175.0°
H5C2C1H369.8°65.0°
H1CHH2120.0°119.9°
H1CC1H362.6°60.0°
HCC1H357.4°59.9°
H2CC1H3177.4°180.0°
H15C14N2H160.1°0.0°
H17C15N2H160.1°0.0°
H18C16C17H190.1°0.0°
H19C17C18H200.2°0.2°
H23C20H21H22120.0°119.9°
H25C23C24H260.3°0.1°
H26C24C25H270.4°0.1°
H27C25C26H280.0°0.0°
H28C26C27H290.4°0.1°

250835

PDB entries from 2026-03-18

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